2-methyl-6-[(4-methylphenyl)methyl]-5-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Chemical Structure Depiction of
2-methyl-6-[(4-methylphenyl)methyl]-5-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
2-methyl-6-[(4-methylphenyl)methyl]-5-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | G020-0604 |
| Compound Name: | 2-methyl-6-[(4-methylphenyl)methyl]-5-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight: | 425.55 |
| Molecular Formula: | C22 H27 N5 O2 S |
| Smiles: | CC1CCN(CC1)C(CSC1=Nc2cn(C)nc2C(N1Cc1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.764 |
| logD: | 2.764 |
| logSw: | -2.8621 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.61 |
| InChI Key: | DBORBDYPYNURLO-UHFFFAOYSA-N |